99J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F36 | C34 | sing | 1.40Å | 1.37Å | |
| C01 | N02 | sing | 1.47Å | 1.49Å | |
| N02 | C07 | sing | 1.47Å | 1.50Å | |
| N02 | C03 | sing | 1.47Å | 1.49Å | |
| F35 | C34 | sing | 1.40Å | 1.38Å | |
| C34 | F37 | sing | 1.40Å | 1.38Å | |
| C34 | C32 | sing | 1.53Å | 1.55Å | |
| C07 | C06 | sing | 1.53Å | 1.55Å | |
| O33 | C32 | sing | 1.43Å | 1.43Å | |
| C03 | C04 | sing | 1.53Å | 1.54Å | |
| C29 | C30 | doub | 1.39Å | 1.41Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.41Å | Aromatic |
| C32 | C28 | sing | 1.51Å | 1.49Å | |
| C04 | N05 | sing | 1.47Å | 1.45Å | |
| C30 | C31 | sing | 1.38Å | 1.41Å | Aromatic |
| C28 | N27 | doub | 1.32Å | 1.35Å | Aromatic |
| C06 | N05 | sing | 1.47Å | 1.45Å | |
| N05 | C08 | sing | 1.40Å | 1.38Å | |
| C31 | C26 | doub | 1.39Å | 1.41Å | Aromatic |
| N27 | C26 | sing | 1.32Å | 1.35Å | Aromatic |
| C08 | C39 | doub | 1.39Å | 1.41Å | Aromatic |
| C08 | C09 | sing | 1.39Å | 1.41Å | Aromatic |
| C39 | C38 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | N23 | sing | 1.39Å | 1.37Å | |
| C21 | C22 | doub | 1.31Å | 1.35Å | |
| C21 | C20 | sing | 1.51Å | 1.46Å | |
| C38 | C11 | doub | 1.39Å | 1.42Å | Aromatic |
| C09 | C10 | doub | 1.38Å | 1.41Å | Aromatic |
| C20 | N19 | sing | 1.47Å | 1.44Å | |
| N23 | N19 | sing | 1.40Å | 1.32Å | |
| N23 | C24 | sing | 1.38Å | 1.34Å | |
| N19 | C17 | sing | 1.35Å | 1.36Å | |
| C10 | C11 | sing | 1.39Å | 1.41Å | Aromatic |
| C11 | N12 | sing | 1.40Å | 1.38Å | |
| N25 | C24 | doub | 1.32Å | 1.35Å | Aromatic |
| N25 | C13 | sing | 1.33Å | 1.35Å | Aromatic |
| C24 | C16 | sing | 1.41Å | 1.38Å | Aromatic |
| N12 | C13 | sing | 1.38Å | 1.38Å | |
| C17 | C16 | sing | 1.47Å | 1.38Å | |
| C17 | O18 | doub | 1.22Å | 1.25Å | |
| C13 | N14 | doub | 1.33Å | 1.36Å | Aromatic |
| C16 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| N14 | C15 | sing | 1.32Å | 1.37Å | Aromatic |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| N12 | H121 | sing | 0.97Å | 1.00Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C22 | H222 | sing | 1.08Å | 1.08Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| O33 | H331 | sing | 0.97Å | 0.95Å | |
| C38 | H381 | sing | 1.08Å | 1.08Å | |
| C39 | H391 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F36 | C34 | F35 | 109.1° | 109.5° |
| F36 | C34 | F37 | 107.0° | 109.5° |
| F36 | C34 | C32 | 110.8° | 109.5° |
| C01 | N02 | C07 | 113.1° | 111.0° |
| C01 | N02 | C03 | 112.7° | 111.0° |
| N02 | C01 | H012 | 109.5° | 109.5° |
| N02 | C01 | H013 | 109.5° | 109.4° |
| N02 | C01 | H011 | 109.4° | 109.4° |
| C07 | N02 | C03 | 112.6° | 110.8° |
| N02 | C07 | C06 | 113.7° | 109.3° |
| N02 | C07 | H071 | 108.4° | 109.5° |
| N02 | C07 | H072 | 108.4° | 109.5° |
| N02 | C03 | C04 | 109.1° | 109.4° |
| N02 | C03 | H032 | 109.5° | 109.5° |
| N02 | C03 | H031 | 109.6° | 109.5° |
| F35 | C34 | F37 | 108.1° | 109.5° |
| F35 | C34 | C32 | 111.3° | 109.5° |
| F37 | C34 | C32 | 110.3° | 109.4° |
| C34 | C32 | O33 | 110.1° | 109.5° |
| C34 | C32 | C28 | 111.5° | 109.5° |
| C34 | C32 | H321 | 107.2° | 109.5° |
| C07 | C06 | N05 | 112.5° | 109.4° |
| C07 | C06 | H062 | 108.7° | 109.5° |
| C07 | C06 | H061 | 108.7° | 109.5° |
| C06 | C07 | H071 | 108.4° | 109.4° |
| C06 | C07 | H072 | 108.4° | 109.5° |
| O33 | C32 | C28 | 111.3° | 109.5° |
| O33 | C32 | H321 | 108.7° | 109.5° |
| C32 | O33 | H331 | 109.5° | 114.0° |
| C03 | C04 | N05 | 109.9° | 109.3° |
| C04 | C03 | H032 | 109.5° | 109.5° |
| C04 | C03 | H031 | 109.5° | 109.5° |
| C03 | C04 | H042 | 109.3° | 109.5° |
| C03 | C04 | H041 | 109.4° | 109.5° |
| C30 | C29 | C28 | 119.1° | 119.3° |
| C29 | C30 | C31 | 120.3° | 118.5° |
| C30 | C29 | H291 | 120.4° | 120.4° |
| C29 | C30 | H301 | 119.8° | 120.7° |
| C29 | C28 | C32 | 124.7° | 119.6° |
| C29 | C28 | N27 | 118.0° | 120.8° |
| C28 | C29 | H291 | 120.5° | 120.3° |
| C32 | C28 | N27 | 117.3° | 119.6° |
| C28 | C32 | H321 | 108.0° | 109.4° |
| C04 | N05 | C06 | 118.4° | 110.9° |
| C04 | N05 | C08 | 118.7° | 111.0° |
| N05 | C04 | H042 | 109.4° | 109.5° |
| N05 | C04 | H041 | 109.3° | 109.5° |
| C30 | C31 | C26 | 119.0° | 119.1° |
| C31 | C30 | H301 | 119.8° | 120.8° |
| C30 | C31 | H311 | 120.5° | 120.4° |
| C28 | N27 | C26 | 125.5° | 121.7° |
| C06 | N05 | C08 | 121.3° | 111.0° |
| N05 | C06 | H062 | 108.7° | 109.5° |
| N05 | C06 | H061 | 108.7° | 109.5° |
| N05 | C08 | C39 | 120.3° | 120.0° |
| N05 | C08 | C09 | 121.2° | 120.0° |
| C31 | C26 | N27 | 118.1° | 120.6° |
| C31 | C26 | N23 | 125.6° | 119.7° |
| C26 | C31 | H311 | 120.5° | 120.5° |
| N27 | C26 | N23 | 116.3° | 119.8° |
| C39 | C08 | C09 | 118.5° | 120.0° |
| C08 | C39 | C38 | 120.7° | 120.0° |
| C08 | C39 | H391 | 119.6° | 120.0° |
| C08 | C09 | C10 | 120.9° | 120.0° |
| C08 | C09 | H091 | 119.6° | 120.0° |
| C39 | C38 | C11 | 121.0° | 120.0° |
| C39 | C38 | H381 | 119.5° | 120.0° |
| C38 | C39 | H391 | 119.6° | 120.0° |
| C26 | N23 | N19 | 129.9° | 125.2° |
| C26 | N23 | C24 | 122.1° | 125.2° |
| C22 | C21 | C20 | 124.3° | 120.0° |
| C22 | C21 | H211 | 117.8° | 120.0° |
| C21 | C22 | H221 | 120.0° | 120.0° |
| C21 | C22 | H222 | 120.0° | 120.0° |
| C21 | C20 | N19 | 106.6° | 109.5° |
| C21 | C20 | H201 | 110.2° | 109.5° |
| C21 | C20 | H202 | 110.2° | 109.5° |
| C20 | C21 | H211 | 117.8° | 120.0° |
| C38 | C11 | C10 | 117.9° | 120.0° |
| C38 | C11 | N12 | 126.6° | 120.0° |
| C11 | C38 | H381 | 119.5° | 120.0° |
| C09 | C10 | C11 | 121.0° | 120.0° |
| C09 | C10 | H101 | 119.5° | 120.0° |
| C10 | C09 | H091 | 119.6° | 120.0° |
| C20 | N19 | N23 | 128.7° | 125.3° |
| C20 | N19 | C17 | 121.4° | 125.3° |
| N19 | C20 | H201 | 110.2° | 109.4° |
| N19 | C20 | H202 | 110.2° | 109.5° |
| N19 | N23 | C24 | 107.9° | 109.6° |
| N23 | N19 | C17 | 109.8° | 109.4° |
| N23 | C24 | N25 | 129.6° | 134.0° |
| N23 | C24 | C16 | 109.5° | 107.3° |
| N19 | C17 | C16 | 107.5° | 107.1° |
| N19 | C17 | O18 | 126.2° | 126.4° |
| C10 | C11 | N12 | 115.5° | 120.0° |
| C11 | C10 | H101 | 119.5° | 120.0° |
| C11 | N12 | C13 | 126.3° | 120.1° |
| C11 | N12 | H121 | 116.8° | 120.0° |
| C24 | N25 | C13 | 121.9° | 120.5° |
| N25 | C24 | C16 | 120.9° | 118.7° |
| N25 | C13 | N12 | 122.2° | 118.9° |
| N25 | C13 | N14 | 117.6° | 122.3° |
| C24 | C16 | C17 | 105.3° | 106.6° |
| C24 | C16 | C15 | 118.5° | 118.8° |
| N12 | C13 | N14 | 120.1° | 118.8° |
| C13 | N12 | H121 | 116.9° | 120.0° |
| C16 | C17 | O18 | 126.3° | 126.5° |
| C17 | C16 | C15 | 136.2° | 134.6° |
| C13 | N14 | C15 | 122.9° | 121.1° |
| C16 | C15 | N14 | 118.2° | 118.7° |
| C16 | C15 | H151 | 120.9° | 120.6° |
| N14 | C15 | H151 | 120.9° | 120.7° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H221 | C22 | H222 | 120.0° | 120.1° |
| H012 | C01 | H013 | 109.5° | 109.5° |
| H012 | C01 | H011 | 109.5° | 109.5° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H032 | C03 | H031 | 109.5° | 109.6° |
| H042 | C04 | H041 | 109.5° | 109.6° |
| H062 | C06 | H061 | 109.5° | 109.5° |
| H071 | C07 | H072 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F36 | C34 | F35 | F37 | 116.1° | 120.0° |
| F36 | C34 | F35 | C32 | 122.6° | 120.0° |
| F36 | C34 | F37 | C32 | 120.6° | 120.0° |
| F36 | C34 | C32 | O33 | 65.0° | 180.0° |
| F36 | C34 | C32 | C28 | 59.1° | 59.9° |
| F36 | C34 | C32 | H321 | 177.0° | 60.0° |
| C01 | N02 | C07 | C03 | 129.2° | 123.8° |
| C01 | N02 | C07 | C06 | 128.6° | 64.5° |
| C01 | N02 | C03 | C04 | 178.7° | 64.5° |
| N02 | C01 | H012 | H013 | 120.0° | 120.0° |
| N02 | C01 | H012 | H011 | 120.0° | 120.0° |
| N02 | C01 | H013 | H011 | 119.9° | 119.9° |
| C01 | N02 | C03 | H032 | 58.8° | 175.5° |
| C01 | N02 | C03 | H031 | 61.3° | 55.4° |
| C01 | N02 | C07 | H071 | 7.9° | 55.4° |
| C01 | N02 | C07 | H072 | 110.8° | 175.5° |
| N02 | C07 | C06 | H071 | 120.7° | 119.9° |
| N02 | C07 | C06 | H072 | 120.6° | 120.0° |
| C07 | N02 | C03 | C04 | 51.9° | 59.4° |
| N02 | C07 | C06 | N05 | 45.4° | 58.5° |
| C07 | N02 | C01 | H012 | 180.0° | 60.0° |
| C07 | N02 | C01 | H013 | 60.0° | 180.0° |
| C07 | N02 | C01 | H011 | 60.0° | 60.0° |
| C07 | N02 | C03 | H032 | 171.8° | 60.6° |
| C07 | N02 | C03 | H031 | 68.1° | 179.3° |
| N02 | C07 | C06 | H062 | 75.0° | 178.4° |
| N02 | C07 | C06 | H061 | 165.8° | 61.6° |
| N02 | C07 | H071 | H072 | 118.1° | 120.1° |
| C03 | N02 | C07 | C06 | 0.6° | 59.4° |
| N02 | C03 | C04 | H032 | 119.9° | 120.0° |
| N02 | C03 | C04 | H031 | 120.0° | 119.9° |
| N02 | C03 | C04 | N05 | 62.7° | 58.4° |
| C03 | N02 | C01 | H012 | 50.8° | 63.8° |
| C03 | N02 | C01 | H013 | 170.9° | 56.3° |
| C03 | N02 | C01 | H011 | 69.2° | 176.2° |
| N02 | C03 | H032 | H031 | 120.2° | 120.0° |
| N02 | C03 | C04 | H042 | 57.4° | 178.4° |
| N02 | C03 | C04 | H041 | 177.3° | 61.5° |
| C03 | N02 | C07 | H071 | 121.2° | 179.2° |
| C03 | N02 | C07 | H072 | 120.0° | 60.6° |
| F35 | C34 | F37 | C32 | 121.9° | 120.0° |
| F35 | C34 | C32 | O33 | 56.7° | 60.0° |
| F35 | C34 | C32 | C28 | 179.3° | 180.0° |
| F35 | C34 | C32 | H321 | 61.4° | 60.1° |
| F37 | C34 | C32 | O33 | 176.7° | 60.0° |
| F37 | C34 | C32 | C28 | 59.2° | 60.0° |
| F37 | C34 | C32 | H321 | 58.7° | 179.9° |
| C34 | C32 | O33 | C28 | 124.1° | 120.0° |
| C34 | C32 | O33 | H321 | 117.1° | 120.0° |
| C34 | C32 | C28 | C29 | 79.5° | 125.0° |
| C34 | C32 | C28 | H321 | 117.4° | 119.9° |
| C34 | C32 | C28 | N27 | 100.4° | 55.0° |
| C34 | C32 | O33 | H331 | 180.0° | 60.0° |
| C07 | C06 | N05 | C04 | 35.5° | 59.4° |
| C07 | C06 | N05 | H062 | 120.5° | 119.9° |
| C07 | C06 | N05 | H061 | 120.4° | 120.0° |
| C07 | C06 | N05 | C08 | 158.8° | 176.8° |
| C07 | C06 | H062 | H061 | 118.6° | 120.0° |
| C06 | C07 | H071 | H072 | 118.1° | 120.1° |
| O33 | C32 | C28 | C29 | 43.8° | 115.0° |
| O33 | C32 | C28 | H321 | 119.2° | 120.0° |
| O33 | C32 | C28 | N27 | 136.3° | 65.0° |
| C03 | C04 | N05 | H042 | 120.1° | 119.9° |
| C03 | C04 | N05 | H041 | 120.1° | 119.9° |
| C03 | C04 | N05 | C06 | 17.0° | 59.3° |
| C03 | C04 | N05 | C08 | 149.1° | 176.8° |
| C04 | C03 | H032 | H031 | 120.1° | 120.1° |
| C03 | C04 | H042 | H041 | 119.8° | 120.1° |
| C30 | C29 | C28 | H291 | 180.0° | 179.7° |
| C30 | C29 | C28 | C32 | 179.8° | 179.7° |
| C29 | C30 | C31 | H301 | 180.0° | 179.7° |
| C30 | C29 | C28 | N27 | 0.1° | 0.3° |
| C29 | C30 | C31 | C26 | 0.9° | 0.0° |
| C29 | C30 | C31 | H311 | 179.0° | 180.0° |
| C29 | C28 | C32 | N27 | 179.9° | 180.0° |
| C28 | C29 | C30 | C31 | 0.1° | 0.3° |
| C29 | C28 | N27 | C26 | 1.1° | 0.0° |
| C28 | C29 | C30 | H301 | 179.9° | 180.0° |
| C29 | C28 | C32 | H321 | 163.0° | 5.0° |
| C32 | C28 | N27 | C26 | 178.9° | 180.0° |
| C32 | C28 | C29 | H291 | 0.1° | 0.0° |
| C28 | C32 | O33 | H331 | 55.9° | 60.0° |
| C04 | N05 | C06 | C08 | 165.7° | 123.9° |
| C04 | N05 | C08 | C39 | 33.0° | 180.0° |
| C04 | N05 | C08 | C09 | 146.8° | 0.7° |
| N05 | C04 | C03 | H032 | 177.4° | 61.5° |
| N05 | C04 | C03 | H031 | 57.3° | 178.3° |
| N05 | C04 | H042 | H041 | 119.8° | 120.1° |
| C04 | N05 | C06 | H062 | 85.0° | 179.3° |
| C04 | N05 | C06 | H061 | 155.9° | 60.7° |
| C30 | C31 | C26 | H311 | 180.0° | 179.9° |
| C30 | C31 | C26 | N27 | 1.8° | 0.2° |
| C30 | C31 | C26 | N23 | 178.4° | 180.0° |
| C31 | C30 | C29 | H291 | 179.9° | 180.0° |
| C28 | N27 | C26 | C31 | 1.9° | 0.2° |
| C28 | N27 | C26 | N23 | 178.9° | 180.0° |
| N27 | C28 | C29 | H291 | 179.9° | 180.0° |
| N27 | C28 | C32 | H321 | 17.0° | 175.0° |
| C06 | N05 | C08 | C39 | 161.3° | 56.2° |
| C06 | N05 | C08 | C09 | 18.9° | 123.1° |
| C06 | N05 | C04 | H042 | 103.1° | 179.2° |
| C06 | N05 | C04 | H041 | 137.0° | 60.6° |
| N05 | C06 | H062 | H061 | 118.6° | 120.1° |
| N05 | C06 | C07 | H071 | 166.1° | 178.4° |
| N05 | C06 | C07 | H072 | 75.2° | 61.5° |
| N05 | C08 | C39 | C09 | 179.9° | 179.3° |
| N05 | C08 | C39 | C38 | 179.7° | 180.0° |
| N05 | C08 | C09 | C10 | 179.7° | 179.8° |
| C08 | N05 | C04 | H042 | 90.8° | 56.9° |
| C08 | N05 | C04 | H041 | 29.1° | 63.3° |
| C08 | N05 | C06 | H062 | 80.7° | 56.9° |
| C08 | N05 | C06 | H061 | 38.4° | 63.2° |
| N05 | C08 | C09 | H091 | 0.3° | 0.2° |
| N05 | C08 | C39 | H391 | 0.3° | 0.7° |
| C31 | C26 | N27 | N23 | 177.0° | 179.8° |
| C31 | C26 | N23 | N19 | 150.4° | 179.7° |
| C31 | C26 | N23 | C24 | 33.6° | 0.3° |
| C26 | C31 | C30 | H301 | 179.1° | 179.7° |
| N27 | C26 | N23 | N19 | 32.9° | 0.1° |
| N27 | C26 | N23 | C24 | 143.1° | 179.9° |
| N27 | C26 | C31 | H311 | 178.2° | 179.7° |
| C08 | C39 | C38 | H391 | 180.0° | 179.3° |
| C08 | C39 | C38 | C11 | 0.5° | 0.4° |
| C39 | C08 | C09 | C10 | 0.2° | 0.5° |
| C39 | C08 | C09 | H091 | 179.8° | 179.5° |
| C08 | C39 | C38 | H381 | 179.6° | 179.5° |
| C09 | C08 | C39 | C38 | 0.2° | 0.7° |
| C08 | C09 | C10 | H091 | 180.0° | 180.0° |
| C08 | C09 | C10 | C11 | 0.4° | 0.1° |
| C08 | C09 | C10 | H101 | 179.6° | 179.8° |
| C09 | C08 | C39 | H391 | 179.8° | 180.0° |
| C39 | C38 | C11 | H381 | 180.0° | 179.9° |
| C39 | C38 | C11 | C10 | 0.7° | 0.0° |
| C39 | C38 | C11 | N12 | 179.3° | 180.0° |
| C26 | N23 | N19 | C20 | 4.9° | 0.0° |
| C26 | N23 | N19 | C24 | 176.4° | 180.0° |
| C26 | N23 | N19 | C17 | 178.1° | 180.0° |
| C26 | N23 | C24 | N25 | 2.3° | 0.3° |
| C26 | N23 | C24 | C16 | 178.2° | 180.0° |
| N23 | C26 | C31 | H311 | 1.6° | 0.0° |
| C22 | C21 | C20 | H211 | 180.0° | 179.9° |
| C22 | C21 | C20 | N19 | 56.6° | 125.1° |
| C22 | C21 | C20 | H201 | 63.0° | 115.0° |
| C22 | C21 | C20 | H202 | 176.1° | 5.0° |
| C21 | C22 | H221 | H222 | 180.0° | 180.0° |
| C21 | C20 | N19 | H201 | 119.6° | 120.0° |
| C21 | C20 | N19 | H202 | 119.5° | 120.0° |
| C21 | C20 | N19 | N23 | 83.5° | 95.0° |
| C21 | C20 | N19 | C17 | 93.2° | 85.0° |
| C21 | C20 | H201 | H202 | 121.4° | 120.0° |
| C20 | C21 | C22 | H221 | 180.0° | 0.0° |
| C20 | C21 | C22 | H222 | 0.0° | 180.0° |
| C38 | C11 | C10 | C09 | 0.7° | 0.2° |
| C38 | C11 | C10 | N12 | 178.7° | 180.0° |
| C38 | C11 | N12 | C13 | 23.8° | 146.3° |
| C38 | C11 | C10 | H101 | 179.3° | 180.0° |
| C38 | C11 | N12 | H121 | 156.2° | 33.7° |
| C11 | C38 | C39 | H391 | 179.5° | 179.8° |
| C09 | C10 | C11 | H101 | 180.0° | 179.8° |
| C09 | C10 | C11 | N12 | 179.4° | 179.8° |
| C20 | N19 | N23 | C17 | 177.0° | 180.0° |
| C20 | N19 | N23 | C24 | 178.6° | 180.0° |
| C20 | N19 | C17 | C16 | 178.5° | 180.0° |
| C20 | N19 | C17 | O18 | 1.8° | 0.0° |
| N19 | C20 | H201 | H202 | 121.3° | 120.0° |
| N19 | C20 | C21 | H211 | 123.4° | 55.0° |
| N19 | N23 | C24 | N25 | 179.1° | 179.7° |
| N19 | N23 | C24 | C16 | 1.4° | 0.0° |
| N23 | N19 | C17 | C16 | 1.2° | 0.0° |
| N23 | N19 | C17 | O18 | 179.0° | 180.0° |
| N23 | N19 | C20 | H201 | 157.0° | 25.0° |
| N23 | N19 | C20 | H202 | 36.1° | 145.0° |
| C24 | N23 | N19 | C17 | 1.6° | 0.0° |
| N23 | C24 | N25 | C16 | 179.5° | 179.7° |
| N23 | C24 | N25 | C13 | 179.7° | 179.7° |
| N23 | C24 | C16 | C17 | 0.6° | 0.0° |
| N23 | C24 | C16 | C15 | 179.7° | 180.0° |
| N19 | C17 | C16 | C24 | 0.4° | 0.0° |
| N19 | C17 | C16 | O18 | 179.7° | 180.0° |
| N19 | C17 | C16 | C15 | 179.2° | 180.0° |
| C17 | N19 | C20 | H201 | 26.3° | 155.0° |
| C17 | N19 | C20 | H202 | 147.2° | 35.0° |
| C10 | C11 | N12 | C13 | 157.6° | 33.7° |
| C10 | C11 | N12 | H121 | 22.4° | 146.4° |
| C11 | C10 | C09 | H091 | 179.6° | 180.0° |
| C10 | C11 | C38 | H381 | 179.3° | 180.0° |
| C11 | N12 | C13 | N25 | 3.2° | 174.7° |
| C11 | N12 | C13 | H121 | 180.0° | 180.0° |
| C11 | N12 | C13 | N14 | 176.5° | 5.6° |
| N12 | C11 | C10 | H101 | 0.6° | 0.0° |
| N12 | C11 | C38 | H381 | 0.8° | 0.0° |
| C24 | N25 | C13 | N12 | 179.9° | 180.0° |
| N25 | C24 | C16 | C17 | 179.8° | 179.8° |
| C24 | N25 | C13 | N14 | 0.2° | 0.2° |
| N25 | C24 | C16 | C15 | 0.1° | 0.2° |
| C13 | N25 | C24 | C16 | 0.2° | 0.0° |
| N25 | C13 | N12 | N14 | 179.7° | 179.7° |
| N25 | C13 | N14 | C15 | 0.1° | 0.2° |
| N25 | C13 | N12 | H121 | 176.8° | 5.3° |
| C24 | C16 | C17 | C15 | 179.6° | 180.0° |
| C24 | C16 | C17 | O18 | 179.9° | 180.0° |
| C24 | C16 | C15 | N14 | 0.0° | 0.2° |
| C24 | C16 | C15 | H151 | 179.9° | 179.8° |
| N12 | C13 | N14 | C15 | 179.9° | 180.0° |
| C17 | C16 | C15 | N14 | 179.6° | 179.7° |
| C17 | C16 | C15 | H151 | 0.4° | 0.2° |
| O18 | C17 | C16 | C15 | 0.5° | 0.0° |
| C13 | N14 | C15 | C16 | 0.0° | 0.0° |
| N14 | C13 | N12 | H121 | 3.5° | 174.4° |
| C13 | N14 | C15 | H151 | 179.9° | 180.0° |
| C16 | C15 | N14 | H151 | 180.0° | 180.0° |
| H101 | C10 | C09 | H091 | 0.5° | 0.2° |
| H201 | C20 | C21 | H211 | 117.1° | 64.9° |
| H202 | C20 | C21 | H211 | 3.9° | 175.0° |
| H211 | C21 | C22 | H221 | 0.0° | 180.0° |
| H211 | C21 | C22 | H222 | 180.0° | 0.0° |
| H012 | C01 | H013 | H011 | 120.0° | 120.1° |
| H032 | C03 | C04 | H042 | 62.5° | 58.4° |
| H032 | C03 | C04 | H041 | 57.4° | 178.5° |
| H031 | C03 | C04 | H042 | 177.4° | 61.7° |
| H031 | C03 | C04 | H041 | 62.7° | 58.4° |
| H062 | C06 | C07 | H071 | 45.6° | 61.7° |
| H062 | C06 | C07 | H072 | 164.3° | 58.4° |
| H061 | C06 | C07 | H071 | 73.5° | 58.3° |
| H061 | C06 | C07 | H072 | 45.2° | 178.4° |
| H291 | C29 | C30 | H301 | 0.1° | 0.3° |
| H301 | C30 | C31 | H311 | 1.0° | 0.3° |
| H321 | C32 | O33 | H331 | 62.9° | 180.0° |
| H381 | C38 | C39 | H391 | 0.4° | 0.2° |
